SCHEMBL9364308

SCHEMBL9364308

COc1cccc2c1CCC(=O)N2CCCN1CCN(c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.77
HTR7 P34969 3/20 0.63
DRD2 P14416 2/20 0.61
DRD3 P35462 2/20 0.61
DRD5 P21918 1/20 0.61

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL9084274 0.99 SIGMAR1 (0.75) SIGMAR1HTR7DRD2DRD3DRD5
SCHEMBL14038154 0.87 SIGMAR1 (0.82) SIGMAR1HTR7DRD2DRD3
SCHEMBL5022801 0.87 SIGMAR1 (1.00) SIGMAR1DRD2DRD3
SCHEMBL9082184 0.87 SIGMAR1 (0.82) SIGMAR1HTR7DRD2DRD3
SCHEMBL30279503 0.87 SIGMAR1 (1.00) SIGMAR1DRD2DRD3
SCHEMBL29405772 0.87 SIGMAR1 (1.00) SIGMAR1DRD2DRD3
SCHEMBL9364940 0.86 SIGMAR1 (0.81) SIGMAR1HTR7DRD2DRD3
Hydrochloric Acid SCHEMBL8844768 0.86 SIGMAR1 (0.98) SIGMAR1DRD2DRD3
SCHEMBL8845371 0.86 SIGMAR1 (0.81) SIGMAR1HTR7DRD2DRD3
Hydrochloric Acid SCHEMBL9085153 0.86 SIGMAR1 (0.80) SIGMAR1HTR7DRD2DRD3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0512525-B1 Carbostyril derivatives and pharmaceutical compositions containing the same for use as a disturbance-of-consciousness improving agent, central nervous system stimulant or sigma receptor agonist OTSUKA PHARMA CO LTD (JP) 1994-11-30 EP claimed
US-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS BRAINCELLS, INC. (US) 2010-01-14 US disclosed
US-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS BRAINCELLS, INC. (US) 2010-01-14 US disclosed
EP-0512525-B1 Carbostyril derivatives and pharmaceutical compositions containing the same for use as a disturbance-of-consciousness improving agent, central nervous system stimulant or sigma receptor agonist OTSUKA PHARMA CO LTD (JP) 1994-11-30 EP disclosed
EP-0512525-A1 Carbostyril derivatives and pharmaceutical compositions containing the same for use as a disturbance-of-consciousness improving agent, central nervous system stimulant or sigma receptor agonist OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-11-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS HTR6, GAP43, HTR5A SIGMAR1 201/4885HTR7 11/4885DRD2 242/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.